Vitas-M small molecule compound
methyl [(6-ethyl-6-methyl-4-oxo-3-phenyl-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-yl)sulfanyl]acetate
Catalog ID
STL307846
SMILES COC(=O)CSc1nc2sc3c(c2c(=O)n1c1ccccc1)CC(OC3)(C)CC
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H22N2O4S2 MW 430.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O4S2/c1-4-21(2)10-14-15(11-27-21)29-18-17(14)19(25)23(13-8-6-5-7-9-13)20(22-18)28-12-16(24)26-3/h5-9H,4,10-12H2,1-3H3InChIKey
WSICIKJUZXWDCJ-UHFFFAOYSA-NSynonyms
314041-82-2314041822
CCC1(CC2=C(CO1)SC3=C2C(=O)N(C(=N3)SCC(=O)OC)C4=CC=CC=C4)C
InChI=1SC21H22N2O4S2c1421(2)101415(112721)291817(14)19(25)23(138657913)20(2218)281216(24)263h59H41012H213H3
methyl((6ethyl6methyl4oxo3phenyl3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin2yl)sulfanyl)acetate
methyl2((6ethyl6methyl4oxo3phenyl4568tetrahydro3Hpyrano(4345)thieno(23d)pyrimidin2yl)thio)acetate
methyl2((6ethyl6methyl4oxo3phenyl58dihydropyrano(23)thieno(24b)pyrimidin2yl)sulfanyl)acetate
MFCD01558036
ZINC000002216831
ZINC000002216833
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